Exemplo n.º 1
0
    }                                                               // The spheres

    /// <summary>
    /// Create a new molecule representation using the contents of a .pdb file.
    /// </summary>
    /// <param name="file">
    /// The .pdb file, that the molecule is parsed from.
    /// </param>
    public static CMoleculeRepresentation ParseFromFile(string file)
    {
        var name  = Path.GetFileNameWithoutExtension(file);
        var atoms = (
            from line in File.ReadLines(file)
            where line.StartsWith("ATOM")
            select CAtom.ParseFromString(line)
            ).ToArray();

        return(new CMoleculeRepresentation(new CMolecula(atoms, name)));
    }
Exemplo n.º 2
0
    public CAtomRepresentation(CAtom atom)
    {
        Atom = atom;

        Sphere = GameObject.CreatePrimitive(PrimitiveType.Sphere);
    }